dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)

C34H40Cl2N2P2Pd — CID 88813042

IUPACdichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)
SMILESCl[Pd]Cl.c1ccc(P(c2ccccc2)N2CCCCC2)cc1.c1ccc(P(c2ccccc2)N2CCCCC2)cc1
InChIInChI=1S/2C17H20NP.2ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-2,4-7,10-13H,3,8-9,14-15H2;2*1H;/q;;;;+2/p-2
InChIKeyKEWSGOQKIRNBOJ-UHFFFAOYSA-L
MW715.98 g/mol
LogP8.42
Rot. Bonds6

About dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)

dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane) (PubChem CID 88813042) has the molecular formula C34H40Cl2N2P2Pd and a molecular weight of 715.98 g/mol. Its IUPAC name is dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane).

Molecular Properties

Compound Namedichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)
PubChem CID88813042
Molecular FormulaC34H40Cl2N2P2Pd
Molecular Weight715.98 g/mol
Exact Mass714.11
IUPAC Namedichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)
SMILESCl[Pd]Cl.c1ccc(P(c2ccccc2)N2CCCCC2)cc1.c1ccc(P(c2ccccc2)N2CCCCC2)cc1
InChIInChI=1S/2C17H20NP.2ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-2,4-7,10-13H,3,8-9,14-15H2;2*1H;/q;;;;+2/p-2
InChIKeyKEWSGOQKIRNBOJ-UHFFFAOYSA-L
XLogP8.42
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500715.98
LogP ≤ 58.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

1,4-Bis(diphenylphosphanyl)piperazine
CID 306013
Dicyclohexyl-phenyl-(trifluoromethyl)phosphanium;1,1,2,2,3,3,4,4,4-nonafluorobutyl(triphenyl)phosphanium;tricyclohexyl(trifluoromethyl)phosphanium;tri(piperidin-1-yl)-(trifluoromethyl)phosphanium
CID 161308710
N-[[chloro-(diethylamino)-diphenyl-lambda5-phosphanyl]methylidene-diphenyl-lambda5-phosphanyl]-N-ethylethanamine
CID 12670171
N-[[diethylamino(diphenyl)-lambda5-phosphanylidene]methylidene-diphenyl-lambda5-phosphanyl]-N-ethylethanamine
CID 12670175
(6S)-4,4-dichloro-11-[4-[(6S)-4,4-dichloro-2,2-diphenyl-1,3,5,7,11-pentaza-2lambda5,4lambda5,6lambda5-triphosphaspiro[5.5]undeca-1,3,5-trien-11-yl]butyl]-2,2-diphenyl-1,3,5,7,11-pentaza-2lambda5,4lambda5,6lambda5-triphosphaspiro[5.5]undeca-1,3,5-triene
CID 139154372
Bis(dichloromethane);(1-diphenylphosphanyl-2,3,4,6,7,8-hexahydro-[1,3,2]diazaborinino[1,2-a][1,3,2]diazaborinin-9-yl)-diphenylphosphane
CID 139171161
N,N-bis(2-diphenylphosphanylethyl)cyclohexanamine;dichlorocobalt
CID 164672463
[Diphenyl(piperidin-1-yl)-lambda5-phosphanylidene]methylidene-diphenyl-piperidin-1-yl-lambda5-phosphane
CID 168352049
Diethylamino-[[diethylamino(diphenyl)-lambda5-phosphanylidene]methyl]-diphenylphosphanium chloride
CID 176441755
4,4-Dichloro-11-[4-(4,4-dichloro-2,2-diphenyl-1,3,5,7,11-pentaza-2lambda5,4lambda5,6lambda5-triphosphaspiro[5.5]undeca-1(6),2,4-trien-11-yl)butyl]-2,2-diphenyl-1,3,5,7,11-pentaza-2lambda5,4lambda5,6lambda5-triphosphaspiro[5.5]undeca-1(6),2,4-triene
CID 5248781
Triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane
CID 13418976
[(2R)-2-[(2R)-1-diphenylphosphanylpiperidin-2-yl]piperidin-1-yl]-diphenylphosphane
CID 9807208

Frequently Asked Questions

What is the IUPAC name of dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)?
The IUPAC name of dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane) (CID 88813042) is dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane).
What is the SMILES notation for dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)?
The canonical SMILES for dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane) is Cl[Pd]Cl.c1ccc(P(c2ccccc2)N2CCCCC2)cc1.c1ccc(P(c2ccccc2)N2CCCCC2)cc1.
What is the InChIKey of dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)?
The InChIKey is KEWSGOQKIRNBOJ-UHFFFAOYSA-L. The full InChI is InChI=1S/2C17H20NP.2ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-2,4-7,10-13H,3,8-9,14-15H2;2*1H;/q;;;;+2/p-2.
What are the key properties of dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)?
dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane) has a molecular weight of 715.98 g/mol, XLogP of 8.42, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane) is sourced from PubChem (CID 88813042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).